SCHEMBL5590717

SCHEMBL5590717

c1ccc(-c2nnc(-c3ccccn3)c(-c3ccccn3)n2)cc1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.59
SMN1; SMN2 Q16637 6/20 0.59
KDM4E B2RXH2 5/20 0.59
LMNA P02545 3/20 0.59
MITF O75030 1/20 0.59
HTT P42858 2/20 0.55
TP53 P04637 2/20 0.53
NPC1 O15118 3/20 0.50
RAB9A P51151 2/20 0.50
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
PKM P14618 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5590610 0.95 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL5590434 0.95 SMN1; SMN2 (0.62) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL5590017 0.88 HIF1A (0.66) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL5590746 0.88 HIF1A (0.66) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL5590833 0.87 TP53 (0.65) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL9148451 0.83 KDM4E (0.57) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL30272734 0.82 HIF1A (0.68) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL149565 0.82 HIF1A (0.68) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL17301596 0.79 TP53 (0.78) HIF1ASMN1; SMN2KDM4ELMNAMITF
SCHEMBL23543006 0.79 KDM4E (0.53) HIF1ASMN1; SMN2KDM4ELMNAMITF

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070020519-A1 Anode active material, manufacturing method thereof and lithium battery using the anode active material SAMSUNG SDI CO., LTD. (KR) 2007-01-25 US disclosed